Chem
J-GLOBAL ID：201607015717766523   Nikkaji number：J3.474.848I

Trifluoromethanesulfonic acid ((E)-1-(4-chlorophenyl)-2-trifluoromethyl-1-butenyl) ester

トリフルオロメタンスルホン酸((E)-1-(4-クロロフェニル)-2-トリフルオロメチル-1-ブテニル)
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C12H9ClF6O3S
Molecular formula furigana： C12-H9-CL-F6-O3-S
Molecular weight： 382.700
InChI： InChI=1S/C12H9ClF6O3S/c1-2-9(11(14,15)16)10(7-3-5-8(13)6-4-7)22-23(20,21)12(17,18)19/h3-6H,2H2,1H3/b10-9+
InChI key： XSGGRMDLNOPGOS-MDZDMXLPSA-N
SMILES： CC/C(=C(\OS(=O)(=O)C(F)(F)F)/c1ccc(Cl)cc1)/C(F)(F)F
Systematic name  (3)：
  • トリフルオロメタンスルホン酸((E)-1-(4-クロロフェニル)-2-トリフルオロメチル-1-ブテニル)
  • (1E)-1-(4-クロロフェニル)-2-(トリフルオロメチル)ブタ-1-エン-1-イル トリフルオロメタンスルホナート
  • (1E)-1-(4-chlorophenyl)-2-(trifluoromethyl)but-1-en-1-yl trifluoromethanesulfonate
Other name (1)：
  • Trifluoromethanesulfonic acid ((E)-1-(4-chlorophenyl)-2-trifluoromethyl-1-butenyl) ester
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